Mol:FL5FECNS0045

From Metabolomics.JP
Jump to: navigation, search

FL5FECNS0045.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 28  0  0  0  0  0  0  0  0999 V2000 
   -1.0913   -1.0139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0866   -0.1889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3815   -1.4304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3377   -1.0220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3424   -0.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3698    0.2195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7713   -0.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0592    0.2114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7963    0.2277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5155   -0.1808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5202   -1.0058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8104   -1.4223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4803    0.2163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4775    1.0540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7652    1.4709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0561    1.0494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8104   -2.2473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3815   -2.2554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0006   -1.4047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7652    2.2554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1085    1.4183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7874    1.0263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2987    0.0786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.7874   -0.5861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2987   -1.2562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  1  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  2  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  5  1  0  0  0  0 
  2  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12  1  2  0  0  0  0 
  7 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16  8  2  0  0  0  0 
 12 17  1  0  0  0  0 
  3 18  2  0  0  0  0 
  4 19  1  0  0  0  0 
 15 20  1  0  0  0  0 
 14 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 10 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 11  1  0  0  0  0 
S  SKP  8 
ID	FL5FECNS0045 
KNApSAcK_ID	C00013514 
NAME	3,5,3'-Trihydroxy-4'-methoxy-6,7-methylenedioxyflavone;7,9-Dihydroxy-6-(3-hydroxy-4-methoxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one 
CAS_RN	261961-81-3 
FORMULA	C17H12O8 
EXACTMASS	344.05321735999996 
AVERAGEMASS	344.27238 
SMILES	COc(c4)c(O)cc(c4)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O3)c(OC3)2)1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox